(4-Methylphenyl) 2-ethoxybenzoate
TL;DR: (4-Methylphenyl) 2-ethoxybenzoate (CAS 80008-63-5) is a chemical compound with molecular formula C16H16O3 and molecular weight 256.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl) 2-ethoxybenzoate
Also Known As: (4-methylphenyl) 2-ethoxybenzoate, 4-methylphenyl2-ethoxybenzoate, 4-METHYLPHENYL 2-ETHOXYBENZOATE, AN-652/41584150
| Molecular Formula | C16H16O3 |
|---|---|
| Molecular Weight | 256.11 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.10995 |
| Heavy Atoms | 19 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 80008-63-5 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C(=O)OC2=CC=C(C=C2)C |
| InChIKey | YNXPPXHCUZSSIR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(4-Methylphenyl) 2-ethoxybenzoate (CAS 80008-63-5), with molecular formula C16H16O3 and molecular weight 256.11 g/mol. IUPAC: (4-methylphenyl) 2-ethoxybenzoate.
Chemical Property Profile of (4-Methylphenyl) 2-ethoxybenzoate
Property Insights of (4-Methylphenyl) 2-ethoxybenzoate
The XLogP value of 3.8 indicates that (4-Methylphenyl) 2-ethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, (4-Methylphenyl) 2-ethoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Methylphenyl) 2-ethoxybenzoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4-Methylphenyl) 2-ethoxybenzoate?
The CAS number of (4-Methylphenyl) 2-ethoxybenzoate is 80008-63-5.
What is the molecular formula of (4-Methylphenyl) 2-ethoxybenzoate?
The molecular formula of (4-Methylphenyl) 2-ethoxybenzoate is C16H16O3.
What is the molecular weight of (4-Methylphenyl) 2-ethoxybenzoate?
The molecular weight of (4-Methylphenyl) 2-ethoxybenzoate is 256.11 g/mol.
Where can I buy (4-Methylphenyl) 2-ethoxybenzoate?
You can request a quote for (4-Methylphenyl) 2-ethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Methylphenyl) 2-ethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Methylphenyl) 2-ethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.